methyl 3-[2-[3,5-bis(trifluoromethyl)phenyl]sulfanylethanoylamino]-4-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[3,5-bis(trifluoromethyl)phenyl]sulfanylethanoylamino]-4-methyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[3,5-bis(trifluoromethyl)phenyl]sulfanylacetyl]amino]-4-methyl-thiophene-2-carboxylate CAS Name: 3-[[2-[[3,5-bis(trifluoromethyl)phenyl]thio]-1-oxoethyl]amino]-4-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[3,5-bis(trifluoromethyl)phenyl]sulfanylacetyl]amino]-4-methylthiophene-2-carboxylate Traditional Name: 3-[[2-[[3,5-bis(trifluoromethyl)phenyl]thio]acetyl]amino]-4-methyl-thiophene-2-carboxylic acid methyl ester Formula: C17H13F6NO3S2 MolecularWeight: 457.410439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1NC(=O)CSC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)OC

Isomeric SMILES

CC1=CSC(=C1NC(=O)CSC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C17H13F6NO3S2/c1-8-6-29-14(15(26)27-2)13(8)24-12(25)7-28-11-4-9(16(18,19)20)3-10(5-11)17(21,22)23/h3-6H,7H2,1-2H3,(H,24,25)